N-(3-bromophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-bromophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(3-bromophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(3-bromophenyl)-1-mesitylsulfonyl-nipecotamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C21H25BrN2O3S/c1-14-10-15(2)20(16(3)11-14)28(26,27)24-9-5-6-17(13-24)21(25)23-19-8-4-7-18(22)12-19/h4,7-8,10-12,17H,5-6,9,13H2,1-3H3,(H,23,25)